Basic information
- Standard SMILES
CCC(=O)c1ccc2c(c1O)C=CCO2- InChIKey
FLHOJYDOUKXBNH-UHFFFAOYSA-N- Molecular formula
- C12H12O3
- Average molar mass
- 204.22 g/mol
Names & identifiers
- Preferred name
- 1-(5-hydroxy-2H-chromen-6-yl)-propan-1-one
- IUPAC
- 1-(5-hydroxy-2H-chromen-6-yl)propan-1-one
Names & synonyms
1-(5-hydroxy-2H-chromen-6-yl)-propan-1-oneSCHEMBL1477642FLHOJYDOUKXBNH-UHFFFAOYSA-N1-(5-hydroxy-2H-chromen-6yl)-propan-1-one
Database identifiers
- PubChem CID
- 22482871
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 46.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 272
Related reactions
12 records
Compound notes
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